N-[2-(1-azanylethyl)-5-(1H-pyrrolo[2,3-b]pyridin-4-ylcarbamoyl)phenyl]furan-2-carboxamide

Systemtic Name: N-[2-(1-azanylethyl)-5-(1H-pyrrolo[2,3-b]pyridin-4-ylcarbamoyl)phenyl]furan-2-carboxamide Openeye Name: N-[2-(1-aminoethyl)-5-(1H-pyrrolo[2,3-b]pyridin-4-ylcarbamoyl)phenyl]furan-2-carboxamide CAS Name: N-[2-(1-aminoethyl)-5-[oxo-(1H-pyrrolo[2,3-b]pyridin-4-ylamino)methyl]phenyl]-2-furancarboxamide IUPAC Name: N-[2-(1-aminoethyl)-5-(1H-pyrrolo[2,3-b]pyridin-4-ylcarbamoyl)phenyl]furan-2-carboxamide Traditional Name: N-[2-(1-aminoethyl)-5-(1H-pyrrolo[2,3-b]pyridin-4-ylcarbamoyl)phenyl]-2-furamide Formula: C21H19N5O3 MolecularWeight: 389.40726

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=C(C=C(C=C1)C(=O)NC2=C3C=CNC3=NC=C2)NC(=O)C4=CC=CO4)N

Isomeric SMILES

CC(C1=C(C=C(C=C1)C(=O)NC2=C3C=CNC3=NC=C2)NC(=O)C4=CC=CO4)N

InChI

InChI=1S/C21H19N5O3/c1-12(22)14-5-4-13(11-17(14)26-21(28)18-3-2-10-29-18)20(27)25-16-7-9-24-19-15(16)6-8-23-19/h2-12H,22H2,1H3,(H,26,28)(H2,23,24,25,27)